>compound Formononetin_Formononetin
#instrument UPLC Q-Tof Premier, Waters
>formula C16H12O4
#smiles COc(c3)ccc(c3)C(=C1)C(=O)c(c2)c(cc(O)c2)O1
#RECORD LC-ESI-QTOF_train_data/PR100744.txt;LC-ESI-QTOF_train_data/PR100312.txt
>charge -1
>ionization [M-H]-
>parentmass 267.06576

>collision 5-60
91.0193 122.8
132.0221 160.6
135.0092 90.86
195.0458 335.7
223.0409 399.1
251.0359 224.5
252.0432 977.0
267.0658 905.4

>collision 5-60
118.0438 159.0
197.0627 392.5
213.0945 170.8
225.0582 164.9
226.0652 177.9
237.058 227.4
253.0533 250.0
254.0608 176.8
269.0814 1544.0

